4-(1,3-Benzodioxol-5-yl)-1-cyclopentyl-3-phenoxyazetidin-2-one
TL;DR: 4-(1,3-Benzodioxol-5-yl)-1-cyclopentyl-3-phenoxyazetidin-2-one (CAS 696639-58-4) is a chemical compound with molecular formula C21H21NO4 and molecular weight 351.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,3-benzodioxol-5-yl)-1-cyclopentyl-3-phenoxyazetidin-2-one
Also Known As: ChemDiv3_006991, IDI1_024901, BAS 09589673, 4-(1,3-benzodioxol-5-yl)-1-cyclopentyl-3-phenoxyazetidin-2-one, BRD-A24054015-001-01-7
| Molecular Formula | C21H21NO4 |
|---|---|
| Molecular Weight | 351.15 g/mol |
| LogP | 3.6888 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 351.14706 |
| Heavy Atoms | 26 |
| Complexity | 816.01575 |
Chemical Identifiers
| CAS Number | 696639-58-4 |
|---|---|
| SMILES | C1CCC(C1)N2C(C(C2=O)OC3=CC=CC=C3)C4=CC5=C(C=C4)OCO5 |
Product Overview
4-(1,3-Benzodioxol-5-yl)-1-cyclopentyl-3-phenoxyazetidin-2-one (CAS 696639-58-4), with molecular formula C21H21NO4 and molecular weight 351.15 g/mol. IUPAC: 4-(1,3-benzodioxol-5-yl)-1-cyclopentyl-3-phenoxyazetidin-2-one.
Chemical Property Profile of 4-(1,3-Benzodioxol-5-yl)-1-cyclopentyl-3-phenoxyazetidin-2-one
Property Insights of 4-(1,3-Benzodioxol-5-yl)-1-cyclopentyl-3-phenoxyazetidin-2-one
The XLogP value of 3.6888 indicates that 4-(1,3-Benzodioxol-5-yl)-1-cyclopentyl-3-phenoxyazetidin-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.0 Ų, 4-(1,3-Benzodioxol-5-yl)-1-cyclopentyl-3-phenoxyazetidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(1,3-Benzodioxol-5-yl)-1-cyclopentyl-3-phenoxyazetidin-2-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(1,3-Benzodioxol-5-yl)-1-cyclopentyl-3-phenoxyazetidin-2-one?
The CAS number of 4-(1,3-Benzodioxol-5-yl)-1-cyclopentyl-3-phenoxyazetidin-2-one is 696639-58-4.
What is the molecular formula of 4-(1,3-Benzodioxol-5-yl)-1-cyclopentyl-3-phenoxyazetidin-2-one?
The molecular formula of 4-(1,3-Benzodioxol-5-yl)-1-cyclopentyl-3-phenoxyazetidin-2-one is C21H21NO4.
What is the molecular weight of 4-(1,3-Benzodioxol-5-yl)-1-cyclopentyl-3-phenoxyazetidin-2-one?
The molecular weight of 4-(1,3-Benzodioxol-5-yl)-1-cyclopentyl-3-phenoxyazetidin-2-one is 351.15 g/mol.
Where can I buy 4-(1,3-Benzodioxol-5-yl)-1-cyclopentyl-3-phenoxyazetidin-2-one?
You can request a quote for 4-(1,3-Benzodioxol-5-yl)-1-cyclopentyl-3-phenoxyazetidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1,3-Benzodioxol-5-yl)-1-cyclopentyl-3-phenoxyazetidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(1,3-Benzodioxol-5-yl)-1-cyclopentyl-3-phenoxyazetidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.